%chk=000296076.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296076

0 1
N -3.089111 0.144832 0.198157
N 0.770924 1.230420 -2.757543
C 0.722874 0.624136 -0.200158
C 1.692821 1.613582 0.548657
C -0.735223 0.820614 0.296759
C -1.733884 -0.138228 -0.376607
C 3.153258 1.395600 0.099273
C 1.156590 -0.818670 0.060251
C 1.275348 3.071927 0.342111
C 0.756696 0.949009 -1.637026
C 4.153174 2.051282 1.047944
C 1.163613 -1.297047 1.382181
C 1.541178 -1.679804 -0.976797
C -3.346993 -0.703465 1.410168
C -4.175152 -0.015519 -0.824752
C 1.548446 -2.610268 1.658332
C 1.925485 -2.995413 -0.696460
C -4.448413 -0.071826 2.263309
C -4.123699 1.135634 -1.830069
C 1.930698 -3.464977 0.619035
H 1.618675 1.377645 1.639380
H -0.774783 0.697610 1.396076
H -1.063471 1.866052 0.113011
H -1.413597 -1.193749 -0.244106
H -1.740330 0.045127 -1.474293
H 3.374475 0.310546 0.035196
H 3.295684 1.789027 -0.926851
H 1.343768 3.377253 -0.709459
H 0.246172 3.257970 0.670888
H 1.925550 3.747040 0.912063
H 5.182594 1.874513 0.714073
H 4.067355 1.655196 2.066029
H 4.010998 3.136966 1.102296
H 0.868353 -0.642457 2.201251
H 1.549325 -1.342544 -2.013519
H -3.615027 -1.751196 1.153410
H -2.409721 -0.755239 2.008007
H -4.126692 -0.990966 -1.355038
H -5.153681 0.009751 -0.293415
H 1.551529 -2.969300 2.686440
H 2.222561 -3.654388 -1.511642
H -4.233868 0.988563 2.454706
H -4.539363 -0.579211 3.228460
H -5.424936 -0.111819 1.767332
H -4.992294 1.116656 -2.495435
H -3.222119 1.098738 -2.453588
H -4.112648 2.105218 -1.314033
H 2.230859 -4.488319 0.834694


%chk=000296076-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296076

0 1
N -3.134436 0.129363 0.142453
N 0.832741 1.207094 -2.810417
C 0.743845 0.618248 -0.200864
C 1.729581 1.621562 0.555229
C -0.742009 0.832782 0.271542
C -1.769337 -0.104433 -0.400348
C 3.198333 1.441146 0.078987
C 1.177440 -0.846815 0.066362
C 1.279925 3.096712 0.439864
C 0.801743 0.924775 -1.651121
C 4.238890 2.073343 1.029347
C 1.150599 -1.340796 1.397660
C 1.605181 -1.717123 -0.966283
C -3.384287 -0.643672 1.390457
C -4.205348 -0.052261 -0.875218
C 1.539775 -2.665985 1.686831
C 1.995064 -3.045410 -0.679147
C -4.451249 0.001446 2.295588
C -4.288702 1.120778 -1.870439
C 1.964818 -3.527110 0.648230
H 1.681208 1.323676 1.623869
H -0.769633 0.698962 1.370125
H -1.055488 1.869694 0.066000
H -1.458199 -1.169162 -0.283887
H -1.778828 0.104802 -1.485469
H 3.421454 0.361997 -0.016941
H 3.304980 1.876951 -0.934766
H 1.193767 3.403229 -0.619576
H 0.311284 3.283594 0.933899
H 2.021981 3.758265 0.919815
H 5.264522 1.884919 0.663075
H 4.161266 1.641203 2.045381
H 4.116349 3.168127 1.116728
H 0.823605 -0.692145 2.219056
H 1.635137 -1.357663 -2.001043
H -3.669044 -1.702643 1.162793
H -2.431704 -0.696489 1.950937
H -4.078207 -1.014915 -1.432838
H -5.169162 -0.126803 -0.339378
H 1.511607 -3.026499 2.721363
H 2.322246 -3.700818 -1.494059
H -4.149818 1.029098 2.563711
H -4.579651 -0.586853 3.223638
H -5.435998 0.056868 1.797181
H -5.107849 0.955978 -2.595402
H -3.353407 1.241618 -2.446598
H -4.478183 2.064050 -1.329045
H 2.267200 -4.556189 0.871415


